N-cyclopropyl-1-[1-[4-(trifluoromethyl)phenyl]carbonylpiperidin-4-yl]piperidin-1-ium-4-carboxamide

Systemtic Name: N-cyclopropyl-1-[1-[4-(trifluoromethyl)phenyl]carbonylpiperidin-4-yl]piperidin-1-ium-4-carboxamide Openeye Name: N-cyclopropyl-1-[1-[4-(trifluoromethyl)benzoyl]-4-piperidyl]piperidin-1-ium-4-carboxamide CAS Name: N-cyclopropyl-1-[1-[oxo-[4-(trifluoromethyl)phenyl]methyl]-4-piperidinyl]-4-piperidin-1-iumcarboxamide IUPAC Name: N-cyclopropyl-1-[1-[4-(trifluoromethyl)benzoyl]piperidin-4-yl]piperidin-1-ium-4-carboxamide Traditional Name: N-cyclopropyl-1-[1-[4-(trifluoromethyl)benzoyl]-4-piperidyl]piperidin-1-ium-4-carboxamide Formula: C22H29F3N3O2+ MolecularWeight: 424.47977

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)C2CC[NH+](CC2)C3CCN(CC3)C(=O)C4=CC=C(C=C4)C(F)(F)F

Isomeric SMILES

C1CC1NC(=O)C2CC[NH+](CC2)C3CCN(CC3)C(=O)C4=CC=C(C=C4)C(F)(F)F

InChI

InChI=1S/C22H28F3N3O2/c23-22(24,25)17-3-1-16(2-4-17)21(30)28-13-9-19(10-14-28)27-11-7-15(8-12-27)20(29)26-18-5-6-18/h1-4,15,18-19H,5-14H2,(H,26,29)/p+1